# generated using pymatgen data_Ba2Ga(IrO3)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.84462935 _cell_length_b 7.09594415 _cell_length_c 7.60481833 _cell_angle_alpha 92.89891112 _cell_angle_beta 95.19252255 _cell_angle_gamma 115.47463090 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2Ga(IrO3)6 _chemical_formula_sum 'Ba2 Ga1 Ir6 O18' _cell_volume 330.43068731 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ba Ba0 1 0.31297569 0.68202650 0.63014905 1.0 Ba Ba1 1 0.68430118 0.31644381 0.37468196 1.0 Ga Ga2 1 0.39107084 0.27189082 0.88218890 1.0 Ir Ir3 1 0.80416646 0.12484419 0.81488687 1.0 Ir Ir4 1 0.19437501 0.87539929 0.18241940 1.0 Ir Ir5 1 0.60649636 0.72076145 0.11759998 1.0 Ir Ir6 1 0.99927075 0.99813498 0.50047559 1.0 Ir Ir7 1 0.81760848 0.61728272 0.80343856 1.0 Ir Ir8 1 0.17773075 0.37882942 0.19694691 1.0 O O9 1 0.92236551 0.72325528 0.57998545 1.0 O O10 1 0.28932017 0.17088506 0.11135010 1.0 O O11 1 0.32199060 0.51339323 0.98713547 1.0 O O12 1 0.47172784 0.55589405 0.31275321 1.0 O O13 1 0.49058245 0.92036477 0.15931502 1.0 O O14 1 0.90156293 0.39871088 0.72431689 1.0 O O15 1 0.71868556 0.83393115 0.88809263 1.0 O O16 1 0.91296460 0.23333257 0.05291154 1.0 O O17 1 0.68755642 0.49856890 0.02303256 1.0 O O18 1 0.07731610 0.27426971 0.42140614 1.0 O O19 1 0.09477635 0.13479634 0.75039754 1.0 O O20 1 0.72521192 0.99674227 0.57014169 1.0 O O21 1 0.09705568 0.60016977 0.27589472 1.0 O O22 1 0.90473348 0.87180936 0.24994317 1.0 O O23 1 0.08727529 0.76695165 0.94375850 1.0 O O24 1 0.50766402 0.07810433 0.82660099 1.0 O O25 1 0.27334468 0.99923677 0.42857352 1.0 O O26 1 0.52786989 0.44397274 0.69160166 1.0